MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009963
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009963
RECORD_TITLE: DECAN-1,10-DIOL DIMETHACRYLATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: DECAN-1,10-DIOL DIMETHACRYLATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C18H30O4
CH$EXACT_MASS: 310.21441
CH$SMILES: CC(=C)C(=O)OCCCCCCCCCCOC(=O)C(C)=C
CH$IUPAC: InChI=1S/C18H30O4/c1-15(2)17(19)21-13-11-9-7-5-6-8-10-12-14-22-18(20)16(3)4/h1,3,5-14H2,2,4H3
CH$LINK: INCHIKEY
LRZPQLZONWIQOJ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7044972
AC$INSTRUMENT: JEOL JMS-D-300
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0159-9100000000-16fe47f453d6f7c51c0e
PK$NUM_PEAK: 69
PK$PEAK: m/z int. rel.int.
27 1.7 17
28 3.6 36
29 2.9 29
39 0.62 6
40 3.1 31
41 42.6 426
42 5 50
43 0.46 5
54 13.3 133
55 27 270
56 3.2 32
57 0.39 4
66 2.7 27
67 20.3 203
68 26.2 262
69 99.99 999
70 11.6 116
71 2.6 26
79 1.7 17
80 0.21 2
81 25.5 255
82 26.5 265
83 26 260
84 0.29 3
86 3.1 31
87 30.9 309
88 2.7 27
93 0.1 1
94 1.9 19
95 20 200
96 21 210
97 1.26 13
98 3.6 36
99 1.5 15
107 1 10
108 0.51 5
109 12.8 128
110 15.9 159
111 3.1 31
112 0.27 3
113 1.5 15
114 0.3 3
121 1.4 14
122 0.05 1
123 2.4 24
124 1.7 17
125 4.6 46
126 0.65 7
127 4.8 48
128 2.4 24
129 0.3 3
136 0.91 9
137 5 50
138 10.8 108
139 3.1 31
150 0.02 0
151 0.3 3
152 0.2 2
153 0.9 9
154 0.55 6
155 3.1 31
172 3.1 31
173 1.7 17
208 0.1 1
224 0.9 9
264 1 10
282 2.1 21
310 0.08 1
311 0.5 5
//
system version 2.2.6-SNAPSHOT